%chk=000236246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236246

0 1
O -0.033427 2.335322 -0.081247
O -0.307418 -1.282684 -1.878733
N 0.362113 -2.582906 -0.148777
C 0.258976 -0.097247 0.152190
C -0.573859 1.072753 -0.461756
C 1.722135 0.267355 0.233792
C 0.086028 -1.346235 -0.718153
C -2.030452 0.949753 -0.057597
C 2.317233 0.485092 1.485400
C 2.488679 0.394409 -0.935131
C -2.862895 0.078751 -0.776178
C -2.555914 1.693107 1.006337
C 3.671165 0.825226 1.563828
C 3.840344 0.734165 -0.848882
C 0.243159 -3.806198 -0.974943
C 0.923797 -2.750379 1.206719
C -4.207303 -0.053847 -0.422722
C -3.903105 1.559266 1.356524
C 4.434796 0.948657 0.399581
C -4.729444 0.684322 0.645306
H -0.143844 -0.303479 1.176586
H -0.459143 1.098413 -1.577511
H 1.731956 0.397032 2.397312
H 2.022968 0.236139 -1.910143
H -2.453980 -0.495734 -1.614417
H -1.922495 2.392375 1.549049
H 0.094590 2.401636 0.885817
H 4.130337 0.997519 2.535906
H 4.431526 0.836606 -1.758284
H -0.162194 -3.550083 -1.976279
H -0.447084 -4.523722 -0.503451
H 1.224197 -4.285356 -1.121734
H 0.235469 -2.343757 1.968063
H 1.899723 -2.238638 1.302199
H 1.082146 -3.815776 1.441024
H -4.850364 -0.730326 -0.983325
H -4.308891 2.142176 2.181117
H 5.487774 1.215596 0.462909
H -5.777799 0.581499 0.917701


%chk=000236246-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236246

0 1
O -0.101567 2.367144 0.433788
O 0.054020 -1.176865 -1.914928
N 0.112237 -2.529570 -0.020582
C 0.435383 -0.055576 0.227011
C -0.464392 1.139927 -0.285893
C 1.919489 0.326195 0.207302
C 0.179531 -1.296280 -0.648341
C -1.942889 0.882006 -0.025880
C 2.570096 0.698313 1.413454
C 2.652191 0.372570 -1.009846
C -2.734880 0.213019 -0.992464
C -2.534108 1.281027 1.199105
C 3.926426 1.098462 1.408888
C 4.005886 0.773862 -1.012912
C -0.193099 -3.726778 -0.826268
C 0.294969 -2.728345 1.430116
C -4.096808 -0.060787 -0.732789
C -3.896384 1.009139 1.456020
C 4.648837 1.137257 0.194501
C -4.682269 0.333608 0.492769
H 0.128546 -0.237307 1.271281
H -0.279082 1.247133 -1.372830
H 2.010366 0.677445 2.356607
H 2.154100 0.081666 -1.941691
H -2.279489 -0.095812 -1.940217
H -1.926355 1.834005 1.922038
H 0.873724 2.515397 0.325860
H 4.414956 1.381482 2.348109
H 4.560479 0.802906 -1.957625
H -0.335299 -3.409635 -1.870189
H -1.116247 -4.214246 -0.460126
H 0.639895 -4.453468 -0.776868
H -0.615658 -2.468462 2.004331
H 1.144324 -2.137532 1.812272
H 0.522250 -3.792042 1.612481
H -4.701139 -0.574707 -1.489114
H -4.347805 1.331434 2.401650
H 5.699587 1.447859 0.188431
H -5.740325 0.126357 0.690646


